N-(3-acetamidophenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(3-acetamidophenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(3-acetamidophenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(3-acetamidophenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-acetamidophenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(3-acetamidophenyl)-1-(3,4-dichlorobenzyl)sulfonyl-isonipecotamide Formula: C21H23Cl2N3O4S MolecularWeight: 484.39602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O4S/c1-14(27)24-17-3-2-4-18(12-17)25-21(28)16-7-9-26(10-8-16)31(29,30)13-15-5-6-19(22)20(23)11-15/h2-6,11-12,16H,7-10,13H2,1H3,(H,24,27)(H,25,28)